In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2009 | 25 | Yes |
Popular Name: 6-methyl-3-phenyl-N-(4-pyridyl)isoxazolo[5,4-b]pyridine-4-carboxamide 6-methyl-3-phenyl-N-(4-pyridyl)i…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 2.47 | 5.25 | -15.64 | 1 | 6 | 0 | 81 | 330.347 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.54 | 3.15 | -38.75 | 0 | 6 | -1 | 87 | 329.339 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.47 | 5.71 | -49.63 | 2 | 6 | 1 | 82 | 331.355 | 3 | ↓ |